Geometry & MOs

Info

ID:	204541
PubChem CID:	79978956
Reduced:	NC17H19 (1)
Stoich.:	AB17C19 (1)
Weight, g/mol:	315.06226
ΔH_f, kcal/mol:	60.73
Dipole, Da:	1.3
IP(EA), eV:	-9.12(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[(4-cyclopropylphenyl)methyl]-4-methylaniline

Drug info:

PubChemData

Smile

C1CC1C2=CC=C(C=C2)CNCC3=CC=CC=C3

DOS

IR

Vibrations